N-[4-bromanyl-3-(trifluoromethyl)phenyl]-5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: N-[4-bromanyl-3-(trifluoromethyl)phenyl]-5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: N-[4-bromo-3-(trifluoromethyl)phenyl]-5-chloro-2-methylsulfanyl-pyrimidine-4-carboxamide CAS Name: N-[4-bromo-3-(trifluoromethyl)phenyl]-5-chloro-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: N-[4-bromo-3-(trifluoromethyl)phenyl]-5-chloro-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: N-[4-bromo-3-(trifluoromethyl)phenyl]-5-chloro-2-(methylthio)pyrimidine-4-carboxamide Formula: C13H8BrClF3N3OS MolecularWeight: 426.63933

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)NC2=CC(=C(C=C2)Br)C(F)(F)F)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)NC2=CC(=C(C=C2)Br)C(F)(F)F)Cl

InChI

InChI=1S/C13H8BrClF3N3OS/c1-23-12-19-5-9(15)10(21-12)11(22)20-6-2-3-8(14)7(4-6)13(16,17)18/h2-5H,1H3,(H,20,22)